Geometry & MOs

Info

ID:	25680
PubChem CID:	628597
Reduced:	OC30H50 (1)
Stoich.:	AB30C50 (1)
Weight, g/mol:	313.18305
ΔH_f, kcal/mol:	-119.78
Dipole, Da:	3.76
IP(EA), eV:	-9.56(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

24-azapentacyclo[9.6.6.14,8.012,17.018,23]tetracosa-1(18),4(24),5,7,11(23),12,14,16-octaene

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(=O)C5(C)C)C)C

DOS

IR

Vibrations