Geometry & MOs

Info

ID:	263733
PubChem CID:	103393692
Reduced:	FCl2N2O2H17C18 (1)
Stoich.:	AB2C2D2E17F18 (1)
Weight, g/mol:	332.209993
ΔH_f, kcal/mol:	-97.42
Dipole, Da:	2.12
IP(EA), eV:	-8.76(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[3-[(2-hydroxycycloheptyl)amino]cyclobutyl]carbamate

Drug info:

PubChemData

Smile

C1C(CC1NC(=O)OCC2=CC=CC=C2)NC3=C(C=C(C=C3Cl)F)Cl

DOS

IR

Vibrations