Geometry & MOs

Info

ID:	311208
PubChem CID:	126589916
Reduced:	N3O3C35H43 (1)
Stoich.:	A3B3C35D43 (1)
Weight, g/mol:	567.346092
ΔH_f, kcal/mol:	-108.26
Dipole, Da:	6.58
IP(EA), eV:	-8.77(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-[4-(2-azaspiro[4.6]undecan-2-yl)-5-[4-(benzylcarbamoyl)phenyl]-2,6-dimethylpyridin-3-yl]acetate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=N1)C)C2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3)N4CCC5(C4)CCCCC5)CC(=O)OC(C)C

DOS

IR

Vibrations