Geometry & MOs

Info

ID:	77280
PubChem CID:	48426011
Reduced:	N3O3C18H25 (1)
Stoich.:	A3B3C18D25 (1)
Weight, g/mol:	376.166604
ΔH_f, kcal/mol:	-132.37
Dipole, Da:	4.51
IP(EA), eV:	-8.61(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-chlorophenyl)methyl]-N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CC1=CC=C(C=C1)N2CCCC2=O

DOS

IR

Vibrations