Geometry & MOs

Info

ID:	354083
PubChem CID:	127285887
Reduced:	ON3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	273.093583
ΔH_f, kcal/mol:	34.97
Dipole, Da:	4.73
IP(EA), eV:	-8.79(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopropyl-N-(5-cyclopropyl-1H-pyrazol-3-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1CC1C2=CC(=NN2)NC(=O)C3CCC4=CC=CC=C34

DOS

IR

Vibrations