Geometry & MOs

Info

ID:	317685
PubChem CID:	126645017
Reduced:	N2F3O3C24H25 (1)
Stoich.:	A2B3C3D24E25 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	-235.35
Dipole, Da:	7.06
IP(EA), eV:	-8.57(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-(1-methylpyrazol-4-yl)-N-[(2R)-2-phenylmethoxypropyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(C2=C1C=C(C=C2)C(F)(F)F)C3=CC(=CC(=C3)OC(C)C)N4CC(C4)C(=O)OC

DOS

IR

Vibrations