Geometry & MOs

Info

ID:	138312
PubChem CID:	52345290
Reduced:	N2F3O3C18H19 (1)
Stoich.:	A2B3C3D18E19 (1)
Weight, g/mol:	291.125073
ΔH_f, kcal/mol:	-230.19
Dipole, Da:	4.88
IP(EA), eV:	-9.03(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(2-chlorophenyl)-N-[(1-cyclopropyltetrazol-5-yl)methyl]-N-methylethanamine

Drug info:

PubChemData

Smile

CN(CCOC1=CC(=CC=C1)F)CC(=O)NC2=CC=CC=C2OC(F)F

DOS

IR

Vibrations