Geometry & MOs

Info

ID:	126923
PubChem CID:	50984533
Reduced:	ClO2N3C17H24 (1)
Stoich.:	AB2C3D17E24 (1)
Weight, g/mol:	339.11384
ΔH_f, kcal/mol:	-90.23
Dipole, Da:	5.24
IP(EA), eV:	-8.54(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chlorophenyl)methyl]-N-propan-2-ylquinoxaline-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC(=C(C=C1)Cl)C(=O)N(C)CC2CCCCN2C

DOS

IR

Vibrations