Geometry & MOs

Info

ID:	351306
PubChem CID:	127280194
Reduced:	O4N5C19H29 (1)
Stoich.:	A4B5C19D29 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-175.91
Dipole, Da:	4.65
IP(EA), eV:	-9.24(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-2-[4-(3,4-dihydro-2H-chromene-3-carbonyl)piperazin-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CN(C1CCCCC1)C(=O)CN2CCN(CC2)C(=O)CN3C=CC(=O)NC3=O

DOS

IR

Vibrations