Geometry & MOs

Info

ID:	320535
PubChem CID:	126661665
Reduced:	N3C11H17 (1)
Stoich.:	A3B11C17 (1)
Weight, g/mol:	294.07316
ΔH_f, kcal/mol:	20.05
Dipole, Da:	3.07
IP(EA), eV:	-8.21(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-[1-(3-bromocyclohexa-2,4-dien-1-yl)but-3-enylimino]-2-methylprop-1-en-1-amine

Drug info:

PubChemData

Smile

C1CN(C[C@@H]1CN)C2=CC=CC=C2N

DOS

IR

Vibrations