Geometry & MOs

Info

ID:	47433
PubChem CID:	10532643
Reduced:	PN4O8C35H53 (1)
Stoich.:	AB4C8D35E53 (1)
Weight, g/mol:	688.375917
ΔH_f, kcal/mol:	-459.28
Dipole, Da:	4.43
IP(EA), eV:	-9.18(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3'R,4'R,5'R,6R,7R)-3',4'-bis[[tert-butyl(dimethyl)silyl]oxy]-5'-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-phenylspiro[5,6-dihydropyrrolo[1,2-c]pyrimidine-7,2'-oxolane]-1,3-dione

Drug info:

PubChemData

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔH_f, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(S_z, S²):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

C[C@@H](C(=O)NCCC1=CC=CC=C1)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC2=CC=C(C=C2)OP(=O)(OC(C)(C)C)OC(C)(C)C)NC(=O)C

DOS

IR

Vibrations

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔHf, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(Sz, S2):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

C[C@@H](C(=O)NCCC1=CC=CC=C1)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC2=CC=C(C=C2)OP(=O)(OC(C)(C)C)OC(C)(C)C)NC(=O)C

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):