Geometry & MOs

Info

ID:	345245
PubChem CID:	127269309
Reduced:	NOC8H10 (2)
Stoich.:	ABC8D10 (2)
Weight, g/mol:	245.152812
ΔH_f, kcal/mol:	-74.59
Dipole, Da:	3.75
IP(EA), eV:	-9.1(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-azatricyclo[4.3.1.13,8]undecan-4-yl(1H-imidazol-5-yl)methanone

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)N(C3)C(=O)C4=C(C=CC=N4)O

DOS

IR

Vibrations