Geometry & MOs

Info

ID:	377861
PubChem CID:	134223926
Reduced:	SC27H32 (1)
Stoich.:	AB27C32 (1)
Weight, g/mol:	348.126263
ΔH_f, kcal/mol:	27.62
Dipole, Da:	2.21
IP(EA), eV:	-8.53(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-pyridin-3-ylphenyl)-1H-benzo[h]quinolin-10-one

Drug info:

PubChemData

Smile

CCCSC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)C(C)(C)C3=CC=C(C=C3)C

DOS

IR

Vibrations