Geometry & MOs

Info

ID:	206620
PubChem CID:	80274398
Reduced:	BrF2C14H17 (1)
Stoich.:	AB2C14D17 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-106.41
Dipole, Da:	2.36
IP(EA), eV:	-9.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(1-ethylcyclopentyl)-1,3,4-oxadiazol-2-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)C(C2(CCCC2)C)Br)F

DOS

IR

Vibrations