Geometry & MOs

Info

ID:	388232
PubChem CID:	134988569
Reduced:	NOC6H8 (2)
Stoich.:	ABC6D8 (2)
Weight, g/mol:	157.089149
ΔH_f, kcal/mol:	-15.8
Dipole, Da:	5.39
IP(EA), eV:	-9.25(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R,3R)-2-methyl-3-phenylcyclopropane-1-carbonitrile

Drug info:

PubChemData

Smile

CCN(CC)C(=O)/C=[N+](/C1=CC=CC=C1)\[O-]

DOS

IR

Vibrations