Geometry & MOs

Info

ID:	141873
PubChem CID:	52943601
Reduced:	NO7C35H57 (1)
Stoich.:	AB7C35D57 (1)
Weight, g/mol:	617.429153
ΔH_f, kcal/mol:	-272.68
Dipole, Da:	4.82
IP(EA), eV:	-9.75(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1CCC2(CC1)OOC3(CC[C@]4([C@@H](C3)CC[C@@H]5[C@@H]4C[C@@H]([C@]6([C@H]5CC[C@@H]6[C@H](C)CCC(=O)NC)C)OC(=O)C)C)OO2

DOS

IR

Vibrations