Geometry & MOs

Info

ID:	248117
PubChem CID:	103079039
Reduced:	O2N4C13H14 (1)
Stoich.:	A2B4C13D14 (1)
Weight, g/mol:	265.121512
ΔH_f, kcal/mol:	-10.91
Dipole, Da:	5.11
IP(EA), eV:	-8.22(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(2-phenylphenoxy)pyrazol-4-amine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)OC2=CC3=C(C=C2)NC(=O)CC3)N

DOS

IR

Vibrations