Geometry & MOs

Info

ID:	362318
PubChem CID:	127307347
Reduced:	O2N5C14H27 (1)
Stoich.:	A2B5C14D27 (1)
Weight, g/mol:	380.202382
ΔH_f, kcal/mol:	-88.21
Dipole, Da:	3.26
IP(EA), eV:	-8.52(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(2,6-difluorophenyl)methyl]piperidin-3-yl]-3-(2-oxoazepan-3-yl)urea

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NC2CCCCNC2=O)C

DOS

IR

Vibrations