Geometry & MOs

Info

ID:	361960
PubChem CID:	127304956
Reduced:	O3N4C21H36 (1)
Stoich.:	A3B4C21D36 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-175.14
Dipole, Da:	3.1
IP(EA), eV:	-8.88(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-3-oxo-4H-1,4-benzoxazine-6-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(C)(C)CNC(=O)CN2C(=O)C3(CCCCC3)NC2=O

DOS

IR

Vibrations