Geometry & MOs

Info

ID:	364700
PubChem CID:	127316000
Reduced:	O3N4C15H26 (1)
Stoich.:	A3B4C15D26 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-143.96
Dipole, Da:	6.37
IP(EA), eV:	-8.8(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1CCCCN1CCNC(=O)CN2C(=O)CN(C2=O)C

DOS

IR

Vibrations