Geometry & MOs

Info

ID:	131647
PubChem CID:	51238364
Reduced:	SN2O4C18H24 (1)
Stoich.:	AB2C4D18E24 (1)
Weight, g/mol:	337.142641
ΔH_f, kcal/mol:	-160.06
Dipole, Da:	5.58
IP(EA), eV:	-9.17(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenoxy)ethyl]-3-phenyl-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)N(C)C3CCS(=O)(=O)C3

DOS

IR

Vibrations