Geometry & MOs

Info

ID:	315116
PubChem CID:	126624495
Reduced:	NO2C7H15 (1)
Stoich.:	AB2C7D15 (1)
Weight, g/mol:	550.208194
ΔH_f, kcal/mol:	-78.75
Dipole, Da:	2.98
IP(EA), eV:	-9.68(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,15E,17E,20S)-10-chloro-5,20-dihydroxy-11,19-dimethoxy-4,8,15-trimethyl-3,23-dioxa-8,21-diazatetracyclo[18.3.1.12,4.19,13]hexacosa-9,11,13(25),15,17-pentaene-7,22-dione

Drug info:

PubChemData

Smile

CC(C)C(=O)C(C)(C)ON

DOS

IR

Vibrations