Geometry & MOs

Info

ID:	358993
PubChem CID:	127297185
Reduced:	O3N4C20H34 (1)
Stoich.:	A3B4C20D34 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-165.6
Dipole, Da:	7.46
IP(EA), eV:	-9.26(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[2-(2,3-dihydro-1-benzofuran-5-yl)acetyl]piperazin-1-yl]-N-(3-methylcyclohexyl)acetamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)NC(=O)CN2CCN(CC2)C(=O)C3CCCN3C(=O)C

DOS

IR

Vibrations