Geometry & MOs

Info

ID:	373336
PubChem CID:	131313429
Reduced:	NSO2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	225.03944
ΔH_f, kcal/mol:	-64.98
Dipole, Da:	5.36
IP(EA), eV:	-9.19(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methyl-1,2-thiazol-4-yl)-2-(1,3-thiazol-5-yl)ethanamine

Drug info:

PubChemData

Smile

CC(C)CN1CC2=CSC(=C2C1)C(=O)O

DOS

IR

Vibrations