Geometry & MOs

Info

ID:	196527
PubChem CID:	78843763
Reduced:	SN3O4C21H33 (1)
Stoich.:	AB3C4D21E33 (1)
Weight, g/mol:	279.231063
ΔH_f, kcal/mol:	-181.82
Dipole, Da:	8.52
IP(EA), eV:	-8.56(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-methyl-N-propan-2-ylpropanamide

Drug info:

PubChemData

Smile

CCCNC(=O)C1CCN(CC1)CC(=O)C2=C(N(C(=C2)C)C3CCS(=O)(=O)C3)C

DOS

IR

Vibrations