Geometry & MOs

Info

ID:	395282
PubChem CID:	135025065
Reduced:	NO5C21H37 (1)
Stoich.:	AB5C21D37 (1)
Weight, g/mol:	303.138992
ΔH_f, kcal/mol:	-197.87
Dipole, Da:	6.36
IP(EA), eV:	-9.38(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(12-methyl-10-tetracyclo[8.3.1.18,12.02,7]pentadeca-2,4,6-trienyl)acetamide

Drug info:

PubChemData

Smile

CC1C[C@H]2C[C@@H]([C@@]3(C2(CCCN(CCC3)C(=O)OC(C)(C)C)C(C1)O)O)O

DOS

IR

Vibrations