Geometry & MOs

Info

ID:	136388
PubChem CID:	52031460
Reduced:	N2O5C25H32 (1)
Stoich.:	A2B5C25D32 (1)
Weight, g/mol:	378.053798
ΔH_f, kcal/mol:	-182.41
Dipole, Da:	7.4
IP(EA), eV:	-8.54(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chloro-4-methylphenyl)-3-(7-chloro-3-oxo-1,4-benzoxazin-4-yl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CCC(=O)NCCC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations