Geometry & MOs

Info

ID:	397604
PubChem CID:	135030456
Reduced:	NO2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	308.067618
ΔH_f, kcal/mol:	-199.61
Dipole, Da:	2.47
IP(EA), eV:	-8.74(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,12R,13R,17R)-7-chloro-15,15-dimethyl-14,16,18-trioxa-2,4,6,9-tetrazapentacyclo[10.5.1.02,10.03,8.013,17]octadeca-3(8),4,6,9-tetraene

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC[C@@H]2[C@H]1N(C3=CC=CC=C23)C(=O)OC(C)(C)C

DOS

IR

Vibrations