Geometry & MOs

Info

ID:	107389
PubChem CID:	50201327
Reduced:	F2O4N5C28H35 (1)
Stoich.:	A2B4C5D28E35 (1)
Weight, g/mol:	567.305684
ΔH_f, kcal/mol:	-244.37
Dipole, Da:	5.63
IP(EA), eV:	-9.0(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]-N-[2-(2,4-dimethoxyanilino)-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=C(C=C(C=C3)F)F)C

DOS

IR

Vibrations