Geometry & MOs

Info

ID:	143262
PubChem CID:	53175985
Reduced:	FSO3N4C15H15 (1)
Stoich.:	ABC3D4E15F15 (1)
Weight, g/mol:	382.050254
ΔH_f, kcal/mol:	-91.75
Dipole, Da:	7.31
IP(EA), eV:	-8.76(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloro-2-methoxyphenyl)-2-ethyl-1-oxopyrrolo[1,2-d][1,2,4]triazine-7-sulfonamide

Drug info:

PubChemData

Smile

CCN1C(=O)C2=CC(=CN2C=N1)S(=O)(=O)NC3=CC(=C(C=C3)C)F

DOS

IR

Vibrations