Geometry & MOs

Info

ID:	174552
PubChem CID:	75783332
Reduced:	N2O4C25H32 (1)
Stoich.:	A2B4C25D32 (1)
Weight, g/mol:	410.220557
ΔH_f, kcal/mol:	-152.5
Dipole, Da:	2.1
IP(EA), eV:	-8.7(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-butyl-2-methyl-3-oxo-1,4-benzoxazin-6-yl)-2-(4-ethylphenoxy)propanamide

Drug info:

PubChemData

Smile

CCCCN1C2=C(C=CC(=C2)NC(=O)COC3=C(C=CC(=C3)C)C(C)C)OC(C1=O)C

DOS

IR

Vibrations