Geometry & MOs

Info

ID:	384260
PubChem CID:	134976644
Reduced:	NC19H23 (1)
Stoich.:	AB19C23 (1)
Weight, g/mol:	510.124943
ΔH_f, kcal/mol:	21.63
Dipole, Da:	2.54
IP(EA), eV:	-8.13(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-cyano-2,3-diphenylindolizin-1-yl) 3,4-dimethoxybenzenesulfonate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C2CCCC2)NC3=CC=CC=C3

DOS

IR

Vibrations