Geometry & MOs

Info

ID:	310215
PubChem CID:	126576820
Reduced:	ClON2C8H9 (1)
Stoich.:	ABC2D8E9 (1)
Weight, g/mol:	280.215078
ΔH_f, kcal/mol:	1.37
Dipole, Da:	5.8
IP(EA), eV:	-10.01(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(3aS,6aR)-2-methyl-5-(methyliminomethyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-yl]carbamate

Drug info:

PubChemData

Smile

C1[C@H](N(C2C1C2)C(=O)CCl)C#N

DOS

IR

Vibrations