Geometry & MOs

Info

ID:	69637
PubChem CID:	47205064
Reduced:	N3O3H11C12 (1)
Stoich.:	A3B3C11D12 (1)
Weight, g/mol:	245.116427
ΔH_f, kcal/mol:	-41.58
Dipole, Da:	5.54
IP(EA), eV:	-9.28(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methoxyphenyl)-N-(1H-pyrazol-5-ylmethyl)acetamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=CC=NN3

DOS

IR

Vibrations