Geometry & MOs

Info

ID:	345455
PubChem CID:	127269755
Reduced:	ON3C7H11 (2)
Stoich.:	AB3C7D11 (2)
Weight, g/mol:	310.236876
ΔH_f, kcal/mol:	-63.13
Dipole, Da:	7.53
IP(EA), eV:	-9.54(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(dimethylamino)cycloheptyl]methyl]-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

C1CCC2=NN=C(N2CC1)CNC(=O)NC3CCCNC3=O

DOS

IR

Vibrations