Geometry & MOs

Info

ID:	294739
PubChem CID:	117487274
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-18.5
Dipole, Da:	4.38
IP(EA), eV:	-8.54(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-methoxy-3-(1-methylpyrrolidin-3-yl)oxyphenyl]-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CN1C(=C(C=N1)C2=C(C(=CC=C2)OC3CCCNC3)OC)N

DOS

IR

Vibrations