Geometry & MOs

Info

ID:	137634
PubChem CID:	52237587
Reduced:	SN3O4C19H21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	364.153541
ΔH_f, kcal/mol:	-99.35
Dipole, Da:	3.73
IP(EA), eV:	-9.29(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-4-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]benzamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CC3

DOS

IR

Vibrations