Geometry & MOs

Info

ID:	160788
PubChem CID:	57389783
Reduced:	N2O2C11H13 (2)
Stoich.:	A2B2C11D13 (2)
Weight, g/mol:	523.279469
ΔH_f, kcal/mol:	-116.68
Dipole, Da:	7.69
IP(EA), eV:	-9.16(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 1-[2-(1-methyl-4-morpholin-4-yl-6-oxopyrimidin-2-yl)acetyl]spiro[2H-indole-3,4'-piperidine]-1'-carboxylate

Drug info:

PubChemData

Smile

C1COCCC12CN(C3=CC=CC=C23)C(=O)CC4=NC(=O)C=C(N4)N5CCOCC5

DOS

IR

Vibrations