Geometry & MOs

Info

ID:	249715
PubChem CID:	103091556
Reduced:	NOC12H17 (1)
Stoich.:	ABC12D17 (1)
Weight, g/mol:	168.07212
ΔH_f, kcal/mol:	-14.05
Dipole, Da:	2.06
IP(EA), eV:	-9.09(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(4-methyl-1,3-thiazol-5-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC=CC=C1COC)N

DOS

IR

Vibrations