Geometry & MOs

Info

ID:	131910
PubChem CID:	51278229
Reduced:	N2O5C15H22 (1)
Stoich.:	A2B5C15D22 (1)
Weight, g/mol:	390.098249
ΔH_f, kcal/mol:	-129.59
Dipole, Da:	1.31
IP(EA), eV:	-9.65(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-N-methyl-N-[1-(3-nitrophenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC(C)COCCCNC(=O)COC1=CC=CC=C1[N+](=O)[O-]

DOS

IR

Vibrations