Geometry & MOs

Info

ID:	274888
PubChem CID:	103812288
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	269.119798
ΔH_f, kcal/mol:	-119.71
Dipole, Da:	5.29
IP(EA), eV:	-9.32(1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-N-[1-(oxan-4-yl)ethyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(CNC)C(=O)NC(C)C1CCOCC1

DOS

IR

Vibrations