Geometry & MOs

Info

ID:	358696
PubChem CID:	127296486
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	359.232125
ΔH_f, kcal/mol:	-112.12
Dipole, Da:	3.62
IP(EA), eV:	-8.44(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[2-[cyclopentyl(propan-2-yl)amino]acetyl]piperazin-1-yl]-2-methyl-1,3-oxazole-4-carbonitrile

Drug info:

PubChemData

Smile

CC(C)N(CCC(=O)NC1=CC2=C(C=C1)OCO2)C3CCCC3

DOS

IR

Vibrations