Geometry & MOs

Info

ID:	356727
PubChem CID:	127292208
Reduced:	N3O3C23H33 (1)
Stoich.:	A3B3C23D33 (1)
Weight, g/mol:	373.200156
ΔH_f, kcal/mol:	-102.86
Dipole, Da:	1.95
IP(EA), eV:	-8.63(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]methyl]-2-methyl-3-oxopiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C=CCN1CCC(CC1)NC(=O)NCC2(CCCC2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations