Geometry & MOs

Info

ID:	249794
PubChem CID:	103092163
Reduced:	NC13H19 (1)
Stoich.:	AB13C19 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	14.16
Dipole, Da:	1.0
IP(EA), eV:	-8.97(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-methyl-4-(3-methylcyclohexyl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)/C=C/C(C)NC)C

DOS

IR

Vibrations