Geometry & MOs

Info

ID:	353727
PubChem CID:	127285304
Reduced:	SO2N5C18H23 (1)
Stoich.:	AB2C5D18E23 (1)
Weight, g/mol:	373.247775
ΔH_f, kcal/mol:	-20.75
Dipole, Da:	3.89
IP(EA), eV:	-8.38(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpiperidin-4-yl)-2-[4-(4-methoxypyridin-2-yl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC(=NC=C1)N2CCN(CC2)CC(=O)NC3=NC4=C(S3)CCC4

DOS

IR

Vibrations