Geometry & MOs

Info

ID:	38549
PubChem CID:	8137039
Reduced:	BrN2O4C15H19 (1)
Stoich.:	AB2C4D15E19 (1)
Weight, g/mol:	407.148121
ΔH_f, kcal/mol:	-123.89
Dipole, Da:	5.21
IP(EA), eV:	-8.99(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-methoxybenzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1Br)C(=O)NCC(=O)NC2CC2)OC

DOS

IR

Vibrations