Geometry & MOs

Info

ID:	262198
PubChem CID:	103276596
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	287.224915
ΔH_f, kcal/mol:	41.41
Dipole, Da:	3.26
IP(EA), eV:	-8.03(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butan-2-yloxy-N-[(3,5-dimethylcyclohex-3-en-1-yl)methyl]aniline

Drug info:

PubChemData

Smile

CC1CC(CC(=C1)C)CNC2=CC=CC3=C2C=NN3

DOS

IR

Vibrations