Geometry & MOs

Info

ID:	345787
PubChem CID:	127270087
Reduced:	ON2C9H14 (2)
Stoich.:	AB2C9D14 (2)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-79.4
Dipole, Da:	6.23
IP(EA), eV:	-8.85(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl-[4-(1H-imidazol-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCCC(CC1)C(=O)NC2=CN(N=C2)CC(=O)NC3CCCC3

DOS

IR

Vibrations