Geometry & MOs

Info

ID:	38033
PubChem CID:	8026508
Reduced:	SN2O2C15H18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	375.252192
ΔH_f, kcal/mol:	-45.32
Dipole, Da:	3.5
IP(EA), eV:	-8.7(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-cyclopentyl-2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C2=CSC(=N2)NC(=O)CC3CCCC3

DOS

IR

Vibrations