Geometry & MOs

Info

ID:	178373
PubChem CID:	76317645
Reduced:	NO4C24H29 (1)
Stoich.:	AB4C24D29 (1)
Weight, g/mol:	301.131408
ΔH_f, kcal/mol:	-74.88
Dipole, Da:	1.83
IP(EA), eV:	-8.53(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,17S,18S,19S)-18-methoxy-5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraen-17-ol

Drug info:

PubChemData

Smile

C1CC1CO[C@H]2C=C3CCN4[C@H]3[C@@H]([C@@H]2OCC5CC5)C6=CC7=C(C=C6C4)OCO7

DOS

IR

Vibrations