Geometry & MOs

Info

ID:	415846
PubChem CID:	135088848
Reduced:	N3C11H15 (2)
Stoich.:	A3B11C15 (2)
Weight, g/mol:	360.204907
ΔH_f, kcal/mol:	44.25
Dipole, Da:	3.03
IP(EA), eV:	-8.29(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5R)-7-[2-(2,3-dimethylphenoxy)-2-methylpropanoyl]-9-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-10-one

Drug info:

PubChemData

Smile

CC1=NC=C2CCC3(C2=N1)CCCN(C3)C4=NC(=NC5=C4CCCC5)N(C)C

DOS

IR

Vibrations