Geometry & MOs

Info

ID:	202964
PubChem CID:	79753831
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	273.104817
ΔH_f, kcal/mol:	-69.73
Dipole, Da:	4.37
IP(EA), eV:	-8.95(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-4-[(1-methylbenzimidazol-2-yl)methyl]-1,2,5-thiadiazol-3-amine

Drug info:

PubChemData

Smile

CCC(CC1=NC2=CC=CC=C2N1CC)(COC)O

DOS

IR

Vibrations