Geometry & MOs

Info

ID:	354019
PubChem CID:	127285676
Reduced:	NOC7H11 (3)
Stoich.:	ABC7D11 (3)
Weight, g/mol:	364.208611
ΔH_f, kcal/mol:	-129.99
Dipole, Da:	3.18
IP(EA), eV:	-8.73(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-acetylpiperidin-4-yl)methyl]-3-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CN1CCOC(C1)CNC(=O)NCC2(CCCCC2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations