Geometry & MOs

Info

ID:	340602
PubChem CID:	127262613
Reduced:	NO5C27H35 (1)
Stoich.:	AB5C27D35 (1)
Weight, g/mol:	467.267173
ΔH_f, kcal/mol:	-227.84
Dipole, Da:	3.01
IP(EA), eV:	-9.16(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (2R,4S)-2-methyl-4-[(4-oxo-4-propan-2-yloxybutanoyl)amino]-5-(4-phenylphenyl)pentanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCC(=O)N[C@H](CC1=CC=C(C=C1)C2=CC=CC=C2)C[C@@H](C)C(=O)OC(C)C

DOS

IR

Vibrations