Geometry & MOs

Info

ID:	342934
PubChem CID:	127266097
Reduced:	O2N4C13H18 (1)
Stoich.:	A2B4C13D18 (1)
Weight, g/mol:	336.089226
ΔH_f, kcal/mol:	-83.4
Dipole, Da:	2.21
IP(EA), eV:	-9.21(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[2-(4-oxoazetidin-2-yl)oxyphenyl]pyrazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)NC(=O)N[C@@H]2CCC[C@@H]2C(=O)N

DOS

IR

Vibrations