Geometry & MOs

Info

ID:	171804
PubChem CID:	75428184
Reduced:	FON5C18H20 (1)
Stoich.:	ABC5D18E20 (1)
Weight, g/mol:	337.19026
ΔH_f, kcal/mol:	29.29
Dipole, Da:	5.19
IP(EA), eV:	-9.0(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methoxyphenyl)-N-[1-(1-phenyltetrazol-5-yl)ethyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)OC)F)NC(C)C2=NN=NN2C3=CC=CC=C3

DOS

IR

Vibrations