Geometry & MOs

Info

ID:	415536
PubChem CID:	135088532
Reduced:	NO3C15H27 (1)
Stoich.:	AB3C15D27 (1)
Weight, g/mol:	648.327148
ΔH_f, kcal/mol:	-167.4
Dipole, Da:	4.21
IP(EA), eV:	-8.67(2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-N-[(10S,18S)-8-methyl-10-(2-methylpropyl)-4,9,12,17-tetraoxo-2-oxa-5,8,11,16-tetrazabicyclo[18.2.2]tetracosa-1(22),20,23-trien-18-yl]-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C3CCOCC3)O

DOS

IR

Vibrations