Geometry & MOs

Info

ID:	435677
PubChem CID:	135192140
Reduced:	N7C30H33 (1)
Stoich.:	A7B30C33 (1)
Weight, g/mol:	390.141342
ΔH_f, kcal/mol:	153.86
Dipole, Da:	7.0
IP(EA), eV:	-8.11(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluoro-4-methylcyclohexa-1,3-dien-1-yl)-N-(2-oxo-1-propylquinolin-6-yl)methanesulfonamide

Drug info:

PubChemData

Smile

CC[C@@H](C1=CC=NC=C1)N2C=CC=C(C2=C)C(=C)NC3=CC=C(C=C3)C(=C)C4=C(N=CN=C4N(C)C)N

DOS

IR

Vibrations