Geometry & MOs

Info

ID:	262191
PubChem CID:	103276026
Reduced:	FNC16H22 (1)
Stoich.:	ABC16D22 (1)
Weight, g/mol:	270.173213
ΔH_f, kcal/mol:	-38.75
Dipole, Da:	3.61
IP(EA), eV:	-8.87(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(3,5-dimethylcyclohex-3-en-1-yl)methylamino]phenoxy]acetonitrile

Drug info:

PubChemData

Smile

CC1CC(CC(=C1)C)CNCC2=CC=C(C=C2)F

DOS

IR

Vibrations