Geometry & MOs

Info

ID:	342076
PubChem CID:	127264789
Reduced:	SN2O2C18H26 (1)
Stoich.:	AB2C2D18E26 (1)
Weight, g/mol:	298.088832
ΔH_f, kcal/mol:	-57.89
Dipole, Da:	5.34
IP(EA), eV:	-8.76(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N'-phenyl-3-thiophen-2-ylpyrazole-4-carbohydrazide

Drug info:

PubChemData

Smile

CC(=CC1=CC=CC=C1)CN2CCN(CC2)C3CCS(=O)(=O)C3

DOS

IR

Vibrations