Geometry & MOs

Info

ID:	205955
PubChem CID:	80182459
Reduced:	NOC17H27 (1)
Stoich.:	ABC17D27 (1)
Weight, g/mol:	273.209264
ΔH_f, kcal/mol:	-68.23
Dipole, Da:	3.18
IP(EA), eV:	-8.52(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methyloxolan-2-yl)methyl]-4-phenylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1C)C)C(C2(CCCO2)C)N)C)C

DOS

IR

Vibrations