Geometry & MOs

Info

ID:	204396
PubChem CID:	79959320
Reduced:	FNC5H8 (3)
Stoich.:	ABC5D8 (3)
Weight, g/mol:	305.171497
ΔH_f, kcal/mol:	-177.03
Dipole, Da:	2.92
IP(EA), eV:	-8.87(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-[3-(3,3,3-trifluoropropyl)-1,2,4-oxadiazol-5-yl]cycloheptan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)CCC(F)(F)F)C)CCCNC(C)C

DOS

IR

Vibrations