Geometry & MOs

Info

ID:	364614
PubChem CID:	127315866
Reduced:	ON4C14H22 (1)
Stoich.:	AB4C14D22 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-15.48
Dipole, Da:	4.65
IP(EA), eV:	-8.72(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-azatricyclo[4.3.1.13,8]undecan-4-yl-(1,3-dimethylpyrazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)N2CCN3CCCCC3C2)C

DOS

IR

Vibrations