Geometry & MOs

Info

ID:	145634
PubChem CID:	53561656
Reduced:	ON4C21H24 (1)
Stoich.:	AB4C21D24 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	30.22
Dipole, Da:	6.51
IP(EA), eV:	-8.41(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)propan-2-yl]-N-methyl-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)C(=O)N(C)C3CCN(CC3)C4=CC=CC=N4

DOS

IR

Vibrations