Geometry & MOs

Info

ID:	140471
PubChem CID:	52703990
Reduced:	N3O4C20H31 (1)
Stoich.:	A3B4C20D31 (1)
Weight, g/mol:	458.208469
ΔH_f, kcal/mol:	-189.09
Dipole, Da:	4.77
IP(EA), eV:	-8.13(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-(2-methylpropyl)benzamide

Drug info:

PubChemData

Smile

C[C@@H]1CCCCN1C(=O)CNC2=CC(=C(C=C2)NC(=O)OC(C)(C)C)OC

DOS

IR

Vibrations