Geometry & MOs

Info

ID:	29252
PubChem CID:	832601
Reduced:	ClNOH14C16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	251.131014
ΔH_f, kcal/mol:	11.82
Dipole, Da:	1.87
IP(EA), eV:	-9.0(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R)-N-(4-methylphenyl)-2-phenylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1[C@@H]([C@H]1C(=O)NC2=CC=CC=C2Cl)C3=CC=CC=C3

DOS

IR

Vibrations