Geometry & MOs

Info

ID:	366870
PubChem CID:	127321772
Reduced:	N3O3C13H21 (1)
Stoich.:	A3B3C13D21 (1)
Weight, g/mol:	288.147393
ΔH_f, kcal/mol:	-134.78
Dipole, Da:	4.2
IP(EA), eV:	-9.34(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(2-methylazepane-1-carbonyl)-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CC1CCCCCN1C(=O)CN2C(=O)CN(C2=O)C

DOS

IR

Vibrations