Geometry & MOs

Info

ID:	263116
PubChem CID:	103340752
Reduced:	SN2O3C15H24 (1)
Stoich.:	AB2C3D15E24 (1)
Weight, g/mol:	314.141262
ΔH_f, kcal/mol:	-90.46
Dipole, Da:	4.69
IP(EA), eV:	-9.25(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(cyclopropylamino)methyl]-N-(2-methoxyethyl)-N-prop-2-enyl-1H-pyrazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CNC)S(=O)(=O)N(CCOC)CC=C

DOS

IR

Vibrations