Geometry & MOs

Info

ID:	214894
PubChem CID:	85083810
Reduced:	SiO6C38H54 (1)
Stoich.:	AB6C38D54 (1)
Weight, g/mol:	635.299536
ΔH_f, kcal/mol:	-317.59
Dipole, Da:	4.87
IP(EA), eV:	-8.87(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[[2-[[1-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoate

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

CC1CC(OC1O)C2C(C(C=CC2=O)C)CCC3CC(OC(O3)(C)C)CCO[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)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

CC1CC(OC1O)C2C(C(C=CC2=O)C)CCC3CC(OC(O3)(C)C)CCO[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):