Geometry & MOs

Info

ID:	291985
PubChem CID:	114000295
Reduced:	NSO5C11H19 (1)
Stoich.:	ABC5D11E19 (1)
Weight, g/mol:	286.098728
ΔH_f, kcal/mol:	-214.53
Dipole, Da:	1.62
IP(EA), eV:	-10.0(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-[(1-methylpyrazol-3-yl)methylsulfonylmethyl]cyclopropyl]acetate

Drug info:

PubChemData

Smile

CNC(=O)CCS(=O)(=O)CC1(CC1)CC(=O)OC

DOS

IR

Vibrations