Geometry & MOs

Info

ID:	21438
PubChem CID:	588239
Reduced:	NO2C8H10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	304.142307
ΔH_f, kcal/mol:	-170.84
Dipole, Da:	4.21
IP(EA), eV:	-9.37(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10-carbamoyloxy-4b,5,6,7,8,8a,9,10-octahydrophenanthren-9-yl) carbamate

Drug info:

PubChemData

Smile

C1CCC2C(C1)C(C(C3=CC=CC=C23)OC(=O)N)OC(=O)N

DOS

IR

Vibrations