Geometry & MOs

Info

ID:	338103
PubChem CID:	127258734
Reduced:	ClNO3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	289.086956
ΔH_f, kcal/mol:	-124.58
Dipole, Da:	2.77
IP(EA), eV:	-9.94(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalen-1-yl N-[(Z)-2-chloro-3-methylbut-1-enyl]carbamate

Drug info:

PubChemData

Smile

CC(CC(=O)Cl)(C1=CC=CC=C1)OC(=O)N

DOS

IR

Vibrations