Geometry & MOs

Info

ID:	280039
PubChem CID:	103846517
Reduced:	SO3N4C6H8 (1)
Stoich.:	AB3C4D6E8 (1)
Weight, g/mol:	201.15175
ΔH_f, kcal/mol:	-23.21
Dipole, Da:	5.17
IP(EA), eV:	-9.6(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-phenylethyl)cyclohex-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C(=O)N)NC1=NC=C(S1)[N+](=O)[O-]

DOS

IR

Vibrations