Geometry & MOs

Info

ID:	46067
PubChem CID:	10521036
Reduced:	NO5H17C19 (1)
Stoich.:	AB5C17D19 (1)
Weight, g/mol:	339.147058
ΔH_f, kcal/mol:	-112.59
Dipole, Da:	4.02
IP(EA), eV:	-8.89(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2S)-2-(1-amino-1-carboxy-3,3-diphenylpropyl)cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCCC/C(=C/1\C=C(C2=C(C1=O)C(=O)C3=CC=CC=C3C2=O)O)/NO

DOS

IR

Vibrations