Geometry & MOs

Info

ID:	346636
PubChem CID:	127271140
Reduced:	N2S2O4C17H26 (1)
Stoich.:	A2B2C4D17E26 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	-165.68
Dipole, Da:	5.64
IP(EA), eV:	-9.52(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(oxolan-2-yl)propan-2-yl]-3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC(CC1CCCO1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations