Geometry & MOs

Info

ID:	237604
PubChem CID:	92719956
Reduced:	ClFON5H21C24 (1)
Stoich.:	ABCD5E21F24 (1)
Weight, g/mol:	493.1001
ΔH_f, kcal/mol:	48.57
Dipole, Da:	4.97
IP(EA), eV:	-8.54(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(4-bromophenyl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(5-phenyl-1,3,4-oxadiazol-2-yl)methanamine

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=N2)[C@@H](C3=C(C=C(C=C3)F)Cl)C4=NN=C(O4)C5=CC=CC=C5

DOS

IR

Vibrations