Geometry & MOs

Info

ID:	296537
PubChem CID:	117582055
Reduced:	OSN3H9C10 (1)
Stoich.:	ABC3D9E10 (1)
Weight, g/mol:	223.077933
ΔH_f, kcal/mol:	54.46
Dipole, Da:	6.17
IP(EA), eV:	-9.2(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(oxan-4-yl)amino]-1,3-thiazole-5-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC=C(O1)N(C)C2=NC=C(S2)C#N

DOS

IR

Vibrations