Geometry & MOs

Info

ID:	77281
PubChem CID:	48426013
Reduced:	ClO2N4C19H25 (1)
Stoich.:	AB2C4D19E25 (1)
Weight, g/mol:	362.150954
ΔH_f, kcal/mol:	-65.09
Dipole, Da:	3.01
IP(EA), eV:	-9.5(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-5-chloro-N-[2-(diethylamino)-2-oxoethyl]-3-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(N(N=C1C)CC2=CC=CC=C2Cl)C

DOS

IR

Vibrations