Geometry & MOs

Info

ID:	170063
PubChem CID:	75192036
Reduced:	SO2N3H25C26 (1)
Stoich.:	AB2C3D25E26 (1)
Weight, g/mol:	435.198048
ΔH_f, kcal/mol:	17.49
Dipole, Da:	6.7
IP(EA), eV:	-8.12(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-N-[4-[(6,7-dimethyl-3-oxo-2H-quinoxalin-2-yl)methylsulfanyl]phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)NC2=CC=C(C=C2)SCC3C(=O)N=C4C=C(C(=CC4=N3)C)C

DOS

IR

Vibrations