Geometry & MOs

Info

ID:	438126
PubChem CID:	135227701
Reduced:	ClFN4H16C19 (1)
Stoich.:	ABC4D16E19 (1)
Weight, g/mol:	378.251858
ΔH_f, kcal/mol:	72.64
Dipole, Da:	2.52
IP(EA), eV:	-9.03(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[8-[(2-methylpropan-2-yl)oxycarbonylamino]octyl]carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CC=CC=C2Cl)C(=NC3=CC=CC=C3F)NNN

DOS

IR

Vibrations