Geometry & MOs

Info

ID:	155483
PubChem CID:	56365819
Reduced:	FSN4O5H17C18 (1)
Stoich.:	ABC4D5E17F18 (1)
Weight, g/mol:	429.031683
ΔH_f, kcal/mol:	-142.91
Dipole, Da:	3.63
IP(EA), eV:	-8.9(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,6-dichloropyridin-3-yl)sulfonyl-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Drug info:

PubChemData

Smile

C1=CN(N=C1)C2=NC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)OCCCC(=O)O)F

DOS

IR

Vibrations