Geometry & MOs

Info

ID:	30138
PubChem CID:	840250
Reduced:	SO2N3C17H19 (1)
Stoich.:	AB2C3D17E19 (1)
Weight, g/mol:	279.125929
ΔH_f, kcal/mol:	-51.41
Dipole, Da:	3.87
IP(EA), eV:	-8.58(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-N-(3-acetylphenyl)-2-phenylcyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3=CN=CC=C3)C(=O)N

DOS

IR

Vibrations