Geometry & MOs

Info

ID:	253268
PubChem CID:	103117293
Reduced:	ON4C16H16 (1)
Stoich.:	AB4C16D16 (1)
Weight, g/mol:	272.163711
ΔH_f, kcal/mol:	41.2
Dipole, Da:	2.06
IP(EA), eV:	-8.75(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[1-(ethylamino)ethyl]phenyl]-1-methylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1NC(=O)C2=C3C=CC=CN3N=C2)N

DOS

IR

Vibrations