Geometry & MOs

Info

ID:	204565
PubChem CID:	79983649
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	191.050177
ΔH_f, kcal/mol:	-28.58
Dipole, Da:	3.65
IP(EA), eV:	-9.11(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-2-(2-cyclopropylphenyl)acetonitrile

Drug info:

PubChemData

Smile

CC(C)CNC(CO)C1=CC=CC=C1C2CC2

DOS

IR

Vibrations