Geometry & MOs

Info

ID:	377087
PubChem CID:	134223125
Reduced:	OPN4C26H31 (1)
Stoich.:	ABC4D26E31 (1)
Weight, g/mol:	283.23
ΔH_f, kcal/mol:	110.3
Dipole, Da:	3.25
IP(EA), eV:	-8.42(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-methyl-3-methylidene-N-[1-(6-propylcyclohexa-1,5-dien-1-yl)ethenyl]hepta-4,6-dien-1-amine

Drug info:

PubChemData

Smile

CNCP1CC2=C1C=C(C=C2)NC/C(=C/C#C)/C=C/3\CC(=C)N(C3)C4CCC(=O)NC4=C

DOS

IR

Vibrations