Geometry & MOs

Info

ID:	235202
PubChem CID:	92304215
Reduced:	ON2C28H30 (1)
Stoich.:	AB2C28D30 (1)
Weight, g/mol:	275.1674
ΔH_f, kcal/mol:	14.24
Dipole, Da:	5.57
IP(EA), eV:	-8.1(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-4-[(1E,3E,5Z)-6-phenylhexa-1,3,5-trienyl]aniline

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)[C@H](CC(=O)N[C@@H](C)C3=CC=CC=C3)C4=CC=C(C=C4)C

DOS

IR

Vibrations