Geometry & MOs

Info

ID:	285242
PubChem CID:	104098779
Reduced:	N3C6H10 (2)
Stoich.:	A3B6C10 (2)
Weight, g/mol:	237.104817
ΔH_f, kcal/mol:	79.96
Dipole, Da:	6.94
IP(EA), eV:	-9.43(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-2-(triazol-1-yl)ethanamine

Drug info:

PubChemData

Smile

CC(C)(C)N1C=C(C=N1)CNCCN2C=CN=N2

DOS

IR

Vibrations