Geometry & MOs

Info

ID:	283328
PubChem CID:	103975278
Reduced:	BrClFNOH12C15 (1)
Stoich.:	ABCDEF12G15 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-49.88
Dipole, Da:	4.32
IP(EA), eV:	-9.56(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[(1,4-dimethylpiperidin-4-yl)methyl]urea

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Br)Cl)C(=O)NCCC2=CC=C(C=C2)F

DOS

IR

Vibrations