Geometry & MOs

Info

ID:	249130
PubChem CID:	103087056
Reduced:	FN5C10H12 (1)
Stoich.:	AB5C10D12 (1)
Weight, g/mol:	319.081158
ΔH_f, kcal/mol:	44.09
Dipole, Da:	6.21
IP(EA), eV:	-10.09(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-chloro-5-(trifluoromethyl)phenyl]tetrazol-5-yl]-N-ethylethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)F)N2C(=NN=N2)C(C)N

DOS

IR

Vibrations