Geometry & MOs

Info

ID:	391204
PubChem CID:	135003527
Reduced:	NO2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	385.204179
ΔH_f, kcal/mol:	-96.0
Dipole, Da:	2.62
IP(EA), eV:	-9.8(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-2-(dibenzylamino)-4-phenylbut-3-enoate

Drug info:

PubChemData

Smile

CCC(C(=O)NC1CCCCC1)OC2=CC=CC=C2[N+](=O)[O-]

DOS

IR

Vibrations