Geometry & MOs

Info

ID:	270220
PubChem CID:	103635485
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	55.48
Dipole, Da:	3.12
IP(EA), eV:	-8.81(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]cycloheptanamine

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2N=C1CNCCC3=NOC(=N3)C

DOS

IR

Vibrations