Geometry & MOs

Info

ID:	416172
PubChem CID:	135089181
Reduced:	SO3N4C14H24 (1)
Stoich.:	AB3C4D14E24 (1)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	9.07
Dipole, Da:	5.04
IP(EA), eV:	-8.82(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclohexyl-3-[[3-(pyrrolidine-1-carbonyl)pyridin-2-yl]amino]propanamide

Drug info:

PubChemData

Smile

CCN1C=C(C(=N1)C)S(=O)(=O)N2C[C@H]3CN([C@@H](C2)COC3)C

DOS

IR

Vibrations