Geometry & MOs

Info

ID:	345790
PubChem CID:	127270090
Reduced:	ON3C16H25 (1)
Stoich.:	AB3C16D25 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-45.58
Dipole, Da:	1.22
IP(EA), eV:	-9.34(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl-(4-imidazol-1-ylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

C1CCCC(CC1)C(=O)N2CCCCC2C3=NC=CN3

DOS

IR

Vibrations