Geometry & MOs

Info

ID:	44335
PubChem CID:	10502843
Reduced:	BrNSO2C21H22 (1)
Stoich.:	ABCD2E21F22 (1)
Weight, g/mol:	432.125612
ΔH_f, kcal/mol:	-28.62
Dipole, Da:	2.03
IP(EA), eV:	-9.35(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(10H-indolo[3,2-b]quinolin-11-ylamino)-3-methoxyphenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1(/C(=C\C(=O)C2=CC=CC=C2)/N(C(=O)C1(C)C)CC3=C(SC=C3)Br)C

DOS

IR

Vibrations