Geometry & MOs

Info

ID:	398540
PubChem CID:	135033737
Reduced:	OPN2C21H29 (1)
Stoich.:	ABC2D21E29 (1)
Weight, g/mol:	397.180681
ΔH_f, kcal/mol:	-72.44
Dipole, Da:	4.02
IP(EA), eV:	-9.03(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl (3S)-3-[[(2S,5S)-1-oxo-2,5-diphenyl-1lambda5-phospholan-1-yl]amino]butanoate

Drug info:

PubChemData

Smile

CC(C)N1[C@H]([C@@H](N(P1(=O)C)C(C)C)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations