Geometry & MOs

Info

ID:	84438
PubChem CID:	49866440
Reduced:	SN3O6C14H19 (1)
Stoich.:	AB3C6D14E19 (1)
Weight, g/mol:	112.100048
ΔH_f, kcal/mol:	-201.22
Dipole, Da:	6.91
IP(EA), eV:	-9.01(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-4-methyl-1,2,3,4-tetrahydropyridin-6-amine

Drug info:

PubChemData

Smile

C1=C/C(=C/NNC(=S)N[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)/C(=O)C=C1

DOS

IR

Vibrations