Geometry & MOs

Info

ID:	208734
PubChem CID:	80572655
Reduced:	SN2O2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	252.068097
ΔH_f, kcal/mol:	-85.7
Dipole, Da:	9.01
IP(EA), eV:	-9.17(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1H-imidazol-2-ylmethyl(methyl)amino]-1,3-thiazole-5-carboxylate

Drug info:

PubChemData

Smile

CC1(CCC(CC1)NC2=NC=C(S2)C(=O)O)C

DOS

IR

Vibrations