Geometry & MOs

Info

ID:	335856
PubChem CID:	127254718
Reduced:	N3O3C13H19 (1)
Stoich.:	A3B3C13D19 (1)
Weight, g/mol:	325.089892
ΔH_f, kcal/mol:	-85.86
Dipole, Da:	10.41
IP(EA), eV:	-8.48(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(tetrazol-1-yl)-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=CN1)OCC(=O)N2CCN(CC2)C

DOS

IR

Vibrations