Geometry & MOs

Info

ID:	214325
PubChem CID:	84975117
Reduced:	O2N3C18H27 (1)
Stoich.:	A2B3C18D27 (1)
Weight, g/mol:	400.106896
ΔH_f, kcal/mol:	-102.51
Dipole, Da:	1.36
IP(EA), eV:	-9.04(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[2-(2,6-dichloroanilino)-2-oxoethyl]-methylamino]-2-oxoethyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C)NC(=O)CN2CCCC(C2)C(=O)N)C

DOS

IR

Vibrations