Geometry & MOs

Info

ID:	220036
PubChem CID:	85165171
Reduced:	O4N6C37H44 (1)
Stoich.:	A4B6C37D44 (1)
Weight, g/mol:	636.414247
ΔH_f, kcal/mol:	-103.34
Dipole, Da:	2.52
IP(EA), eV:	-8.98(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-bis[1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-yl]-3,7-diazabicyclo[3.3.1]nonan-9-one

Drug info:

PubChemData

Smile

CN(C(CC1=CC2=CC=CC=C2C=C1)C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CCCCN)C(=O)N)C(=O)C4=CC=CC(=C4)CN

DOS

IR

Vibrations