Geometry & MOs

Info

ID:	186012
PubChem CID:	77378730
Reduced:	ClO4N5C18H22 (1)
Stoich.:	AB4C5D18E22 (1)
Weight, g/mol:	467.197569
ΔH_f, kcal/mol:	-64.18
Dipole, Da:	6.01
IP(EA), eV:	-10.03(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-chlorophenyl)methylcarbamoyl-methylamino]-4-methylpentyl] N-naphthalen-2-ylcarbamate

Drug info:

PubChemData

Smile

CC(CO)N1C2CC(CCC2N3C=NC(=C3C1=O)C4=NOC(=N4)C5(CC5)O)Cl

DOS

IR

Vibrations