Geometry & MOs

Info

ID:	139418
PubChem CID:	52528141
Reduced:	SN2O5C14H16 (1)
Stoich.:	AB2C5D14E16 (1)
Weight, g/mol:	373.247775
ΔH_f, kcal/mol:	-127.83
Dipole, Da:	7.44
IP(EA), eV:	-9.6(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-[amino-(6-piperidin-1-ylpyridin-3-yl)methylidene]amino]oxy-N-[(1S,2R)-2-methylcyclohexyl]acetamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)[C@H](C)OC2=CC=C(C=C2)S(=O)(=O)C

DOS

IR

Vibrations