Geometry & MOs

Info

ID:	365193
PubChem CID:	127317010
Reduced:	O2N5C21H29 (1)
Stoich.:	A2B5C21D29 (1)
Weight, g/mol:	382.211724
ΔH_f, kcal/mol:	-38.04
Dipole, Da:	3.86
IP(EA), eV:	-8.71(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]propanoyl]-1,3-dihydroquinoxalin-2-one

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCOC2=CC=CC=C12)N3CCN(CC3)CC4=NC=CN4C

DOS

IR

Vibrations