Geometry & MOs

Info

ID:	30064
PubChem CID:	839399
Reduced:	N3O4H7C13 (1)
Stoich.:	A3B4C7D13 (1)
Weight, g/mol:	348.147393
ΔH_f, kcal/mol:	-1.06
Dipole, Da:	6.93
IP(EA), eV:	-9.99(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=NC=CC(=C3)[N+](=O)[O-]

DOS

IR

Vibrations