Geometry & MOs

Info

ID:	353124
PubChem CID:	127284304
Reduced:	O2N3C18H33 (1)
Stoich.:	A2B3C18D33 (1)
Weight, g/mol:	345.168856
ΔH_f, kcal/mol:	-137.37
Dipole, Da:	2.09
IP(EA), eV:	-8.83(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexylamino)-2-oxoethyl]-2-methyl-3-oxo-4H-1,4-benzoxazine-8-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC(=O)NC1CCCCC1)N2CCCCC2

DOS

IR

Vibrations