Geometry & MOs

Info

ID:	184475
PubChem CID:	77165460
Reduced:	O3N5C22H31 (1)
Stoich.:	A3B5C22D31 (1)
Weight, g/mol:	501.262757
ΔH_f, kcal/mol:	-62.92
Dipole, Da:	6.21
IP(EA), eV:	-9.4(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-6-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]carbamoyl]-5-azaspiro[2.5]octane-7-carboxylic acid

Drug info:

PubChemData

Smile

CC(C(=O)NC(C1CCCCC1)C(=O)N2CCCC2C3=NOC4=C3N=CC=C4)NC

DOS

IR

Vibrations