Geometry & MOs

Info

ID:	358989
PubChem CID:	127297181
Reduced:	N3O4C18H31 (1)
Stoich.:	A3B4C18D31 (1)
Weight, g/mol:	372.252526
ΔH_f, kcal/mol:	-193.83
Dipole, Da:	4.63
IP(EA), eV:	-9.08(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylcyclohexyl)-2-[4-(3-pyridin-4-ylpropanoyl)piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)NC(=O)CN2CCN(CC2)C(=O)C3COCCO3

DOS

IR

Vibrations