Geometry & MOs

Info

ID:	348102
PubChem CID:	127273164
Reduced:	ON2C10H12 (2)
Stoich.:	AB2C10D12 (2)
Weight, g/mol:	382.200491
ΔH_f, kcal/mol:	-34.48
Dipole, Da:	6.22
IP(EA), eV:	-8.54(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-cyclopentyloxypyridin-3-yl)-4-(3-hydroxyphenyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)OC2=NC=C(C=C2)NC(=O)N3CCCC3C4=CN=CC=C4

DOS

IR

Vibrations