Geometry & MOs

Info

ID:	26106
PubChem CID:	638974
Reduced:	OC7H14 (1)
Stoich.:	AB7C14 (1)
Weight, g/mol:	226.034689
ΔH_f, kcal/mol:	-59.63
Dipole, Da:	2.43
IP(EA), eV:	-9.94(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(aminomethyl)-1,3-thiazol-2-yl]-1,3-thiazol-4-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)(C)/C=C/CO

DOS

IR

Vibrations