Geometry & MOs

Info

ID:	57019
PubChem CID:	22395228
Reduced:	ClS4N8O9C28H29 (1)
Stoich.:	AB4C8D9E28F29 (1)
Weight, g/mol:	142.020084
ΔH_f, kcal/mol:	-170.16
Dipole, Da:	10.75
IP(EA), eV:	-9.07(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-1,3-thiazol-4-yl)acetaldehyde

Drug info:

PubChemData

Smile

CN1C(=NC(=O)C(=O)N1)SC2(CSC3C(C(=O)N3C2C(=O)OCC4=CC=C(C=C4)OC)NC(=O)/C=N/OC(C5=CSC=N5)NC(=O)CCl)SC

DOS

IR

Vibrations