Geometry & MOs

Info

ID:	175790
PubChem CID:	75947748
Reduced:	N2O2C13H24 (1)
Stoich.:	A2B2C13D24 (1)
Weight, g/mol:	446.211804
ΔH_f, kcal/mol:	-128.94
Dipole, Da:	3.84
IP(EA), eV:	-9.39(1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(2-anilinobenzoyl)piperidin-3-yl]methyl]-3-(3-fluorophenyl)urea

Drug info:

PubChemData

Smile

CCC(CCNC(=O)C(C)C)N1CCCC1=O

DOS

IR

Vibrations