Geometry & MOs

Info

ID:	294738
PubChem CID:	117487251
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-55.35
Dipole, Da:	2.1
IP(EA), eV:	-8.71(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxy-3-piperidin-3-yloxyphenyl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CN1CC(CC1C2=CC(=CC=C2)N3CC(=O)NCC3=O)CN

DOS

IR

Vibrations