Geometry & MOs

Info

ID:	174337
PubChem CID:	75754387
Reduced:	ClN2O2C24H39 (1)
Stoich.:	AB2C2D24E39 (1)
Weight, g/mol:	328.15537
ΔH_f, kcal/mol:	-139.71
Dipole, Da:	6.59
IP(EA), eV:	-8.96(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[tert-butyl-(2-chloroacetyl)amino]-2-(furan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C(=O)NC(C)(C)CC(C)(C)C)N(C(=O)CCl)C(C)(C)C)C

DOS

IR

Vibrations