Geometry & MOs

Info

ID:	441183
PubChem CID:	135233488
Reduced:	O3N6C22H30 (1)
Stoich.:	A3B6C22D30 (1)
Weight, g/mol:	437.402151
ΔH_f, kcal/mol:	-24.07
Dipole, Da:	1.38
IP(EA), eV:	-8.41(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-6-[3-methyl-5-methylidene-4-[(8E)-3-methyl-8-(2-methylpropyl)undeca-1,8-dien-2-yl]cyclohexa-1,3-dien-1-yl]hex-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)CNC1=C(N=C(C=C1)C2CC3CN(CC3C2)C(=O)C4=NC=CO4)N(C)N=O

DOS

IR

Vibrations