Geometry & MOs

Info

ID:	129623
PubChem CID:	51073351
Reduced:	N4O4C17H20 (1)
Stoich.:	A4B4C17D20 (1)
Weight, g/mol:	272.127326
ΔH_f, kcal/mol:	-110.42
Dipole, Da:	0.74
IP(EA), eV:	-9.62(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylethyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1CCCCN1C(=O)CN2C(=O)C3=CC=CC=C3N=N2

DOS

IR

Vibrations