Geometry & MOs

Info

ID:	188002
PubChem CID:	77653102
Reduced:	NO2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	360.204907
ΔH_f, kcal/mol:	-174.38
Dipole, Da:	6.42
IP(EA), eV:	-9.52(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[cyclohexyl-(1-phenylmethoxycarbonylpyrrolidin-3-yl)amino]acetic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)(C2CCN(C2)C(=O)OCC3=CC=CC=C3)NCC(=O)O

DOS

IR

Vibrations