Geometry & MOs

Info

ID:	248992
PubChem CID:	103086084
Reduced:	OSN5C12H19 (1)
Stoich.:	ABC5D12E19 (1)
Weight, g/mol:	285.12013
ΔH_f, kcal/mol:	51.54
Dipole, Da:	7.1
IP(EA), eV:	-9.49(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[1-[[2-(trifluoromethyl)phenyl]methyl]tetrazol-5-yl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CSC=C1)N2C(=NN=N2)C(C)NCCOC

DOS

IR

Vibrations