Geometry & MOs

Info

ID:	299892
PubChem CID:	117852202
Reduced:	N2O3C19H26 (1)
Stoich.:	A2B3C19D26 (1)
Weight, g/mol:	934.378396
ΔH_f, kcal/mol:	-119.23
Dipole, Da:	6.77
IP(EA), eV:	-9.34(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[4-[6,8-dinaphthalen-2-yl-4-[4-(2-phenylbenzimidazol-1-yl)phenyl]quinazolin-2-yl]phenyl]ethenyl]-N-(pyridin-2-ylmethyl)aniline

Drug info:

PubChemData

Smile

CC1=C(C=CC2=C1COC2=O)[C@H](CN3CCC4(CCNC4)CC3)O

DOS

IR

Vibrations