Geometry & MOs

Info

ID:	317610
PubChem CID:	126644327
Reduced:	SO2N3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	421.21139
ΔH_f, kcal/mol:	-27.45
Dipole, Da:	3.36
IP(EA), eV:	-8.59(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(1S,2S)-2-[(4-methoxyphenyl)methoxy]cyclopentyl]-5-(1-methylpyrazol-4-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N=C(S2)OC3=CC=C(C=C3)NC(=O)NC(C)C

DOS

IR

Vibrations