Geometry & MOs

Info

ID:	200255
PubChem CID:	79373067
Reduced:	ClOC10H19 (1)
Stoich.:	ABC10D19 (1)
Weight, g/mol:	301.066717
ΔH_f, kcal/mol:	-94.08
Dipole, Da:	3.3
IP(EA), eV:	-9.71(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1-aminoethyl)-1,3-thiazol-2-yl]-1-ethylimidazole-4-sulfonamide

Drug info:

PubChemData

Smile

CC(C)CC1C(CCCO1)CCl

DOS

IR

Vibrations