Geometry & MOs

Info

ID:	438009
PubChem CID:	135227520
Reduced:	NOC10H18 (2)
Stoich.:	ABC10D18 (2)
Weight, g/mol:	267.1987
ΔH_f, kcal/mol:	-122.6
Dipole, Da:	2.38
IP(EA), eV:	-9.01(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3Z)-hexa-1,3-dien-2-yl]-N-[(3E)-hexa-3,5-dien-3-yl]-4-methylaniline

Drug info:

PubChemData

Smile

CCC1C(C1N)C(C2C(C3CC(C(CCC3(N2)C)C)C)O)C(=O)C

DOS

IR

Vibrations