Geometry & MOs

Info

ID:	366835
PubChem CID:	127320423
Reduced:	N2O2C9H14 (2)
Stoich.:	A2B2C9D14 (2)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-135.67
Dipole, Da:	3.65
IP(EA), eV:	-9.7(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NOC(=N1)COCC(=O)N2CCC(CC2)NC(=O)C3CCCCC3

DOS

IR

Vibrations