Geometry & MOs

Info

ID:	370858
PubChem CID:	127341124
Reduced:	ON5C21H31 (1)
Stoich.:	AB5C21D31 (1)
Weight, g/mol:	379.213888
ΔH_f, kcal/mol:	-12.3
Dipole, Da:	3.42
IP(EA), eV:	-9.11(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-chloropyridin-2-yl)piperazin-1-yl]-N-(1-propan-2-ylpiperidin-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1CCCC(C1C)NC(=O)CN2CCCC(C2)C3=NN=C4N3C=CC=C4

DOS

IR

Vibrations