Geometry & MOs

Info

ID:	262204
PubChem CID:	103276925
Reduced:	FN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	257.21435
ΔH_f, kcal/mol:	-45.42
Dipole, Da:	4.79
IP(EA), eV:	-8.81(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-[(3,5-dimethylcyclohex-3-en-1-yl)methyl]-1-(4-methylphenyl)ethanamine

Drug info:

PubChemData

Smile

CC1CC(CC(=C1)C)CNC2=C(C=CC=C2F)[N+](=O)[O-]

DOS

IR

Vibrations