Geometry & MOs

Info

ID:	364297
PubChem CID:	127315396
Reduced:	ON2C10H16 (2)
Stoich.:	AB2C10D16 (2)
Weight, g/mol:	346.236876
ΔH_f, kcal/mol:	-79.59
Dipole, Da:	3.47
IP(EA), eV:	-8.28(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyloxy-N-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]butanamide

Drug info:

PubChemData

Smile

CC1CCCCC1OCC(=O)NCC2=CN=C(C=C2)N3CCN(CC3)C

DOS

IR

Vibrations