Geometry & MOs

Info

ID:	423757
PubChem CID:	135120163
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	327.125277
ΔH_f, kcal/mol:	9.85
Dipole, Da:	6.31
IP(EA), eV:	-8.61(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-4-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(CNC2=C(C=CC=N2)C(=O)N3CCCC3)C4=CN=CC=C4

DOS

IR

Vibrations