Geometry & MOs

Info

ID:	377099
PubChem CID:	134223137
Reduced:	NO3C19H25 (1)
Stoich.:	AB3C19D25 (1)
Weight, g/mol:	315.183444
ΔH_f, kcal/mol:	-130.19
Dipole, Da:	1.41
IP(EA), eV:	-9.2(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S,4R)-6-oxatetracyclo[10.2.1.02,11.03,8]pentadeca-2(11),3(8),9-trien-4-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@H]1COCC2=C1C3=C(C=C2)[C@H]4CC[C@@H]3C4

DOS

IR

Vibrations