Geometry & MOs

Info

ID:	95814
PubChem CID:	50015319
Reduced:	FO4N5C28H36 (1)
Stoich.:	AB4C5D28E36 (1)
Weight, g/mol:	551.310769
ΔH_f, kcal/mol:	-197.37
Dipole, Da:	4.57
IP(EA), eV:	-9.02(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[5-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)C)NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=CC=CC=C3F

DOS

IR

Vibrations