Geometry & MOs

Info

ID:	55749
PubChem CID:	17396386
Reduced:	O2N5C16H17 (1)
Stoich.:	A2B5C16D17 (1)
Weight, g/mol:	319.099063
ΔH_f, kcal/mol:	-9.45
Dipole, Da:	2.52
IP(EA), eV:	-9.36(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-acetamido-1,3-thiazol-4-yl)methyl 3-(dimethylamino)benzoate

Drug info:

PubChemData

Smile

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CCN3C=CN=C3

DOS

IR

Vibrations