Geometry & MOs

Info

ID:	203256
PubChem CID:	79801986
Reduced:	N2O3C13H26 (1)
Stoich.:	A2B3C13D26 (1)
Weight, g/mol:	235.114319
ΔH_f, kcal/mol:	-179.87
Dipole, Da:	8.09
IP(EA), eV:	-9.57(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-(4-methylthiophen-3-yl)-4-propylpyrazol-3-amine

Drug info:

PubChemData

Smile

CCC(C)(C(=O)O)NC(=O)N(C)C(C)C(C)(C)C

DOS

IR

Vibrations