Geometry & MOs

Info

ID:	349707
PubChem CID:	127275859
Reduced:	SN3O4C19H21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	290.120132
ΔH_f, kcal/mol:	-106.82
Dipole, Da:	2.87
IP(EA), eV:	-8.94(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-1-methyl-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C(C)NC(=O)C2CCCN2C(=O)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations