Geometry & MOs

Info

ID:	46215
PubChem CID:	10523263
Reduced:	O2S2N5H13C16 (1)
Stoich.:	A2B2C5D13E16 (1)
Weight, g/mol:	371.293663
ΔH_f, kcal/mol:	73.81
Dipole, Da:	7.69
IP(EA), eV:	-8.82(-2.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,5R,7R,8R,10S,11S,14R,15S)-14-[(2S)-1-azidopropan-2-yl]-8-methoxy-2,15-dimethylpentacyclo[8.7.0.02,7.05,7.011,15]heptadecane

Drug info:

PubChemData

Smile

C1=CC=C\2C(=C1)C=CC(=O)/C2=C/C=C\3/C(=O)N(C(=S)NN3)NC(=S)N

DOS

IR

Vibrations