Geometry & MOs

Info

ID:	157513
PubChem CID:	56435364
Reduced:	SN2O5C20H24 (1)
Stoich.:	AB2C5D20E24 (1)
Weight, g/mol:	430.22162
ΔH_f, kcal/mol:	-160.48
Dipole, Da:	10.87
IP(EA), eV:	-8.91(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanoyl]-N-pentan-3-yl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C)N(C)C(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations