Geometry & MOs

Info

ID:	136393
PubChem CID:	52032220
Reduced:	ClFO2N4C24H26 (1)
Stoich.:	ABC2D4E24F26 (1)
Weight, g/mol:	440.202382
ΔH_f, kcal/mol:	-89.88
Dipole, Da:	1.65
IP(EA), eV:	-8.28(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-difluorophenyl)methyl]-3-[3-(4-methylpiperidin-1-yl)-2-oxoquinoxalin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC3=CC=CC=C3N(C2=O)CCC(=O)NCC4=C(C=C(C=C4)F)Cl

DOS

IR

Vibrations