Geometry & MOs

Info

ID:	173960
PubChem CID:	75705646
Reduced:	Cl2N3O5C19H21 (1)
Stoich.:	A2B3C5D19E21 (1)
Weight, g/mol:	356.18667
ΔH_f, kcal/mol:	-102.81
Dipole, Da:	9.34
IP(EA), eV:	-9.89(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(2-chloroacetyl)-(furan-2-ylmethyl)amino]-3-ethylpentanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C(C1=C(C=CC(=C1)[N+](=O)[O-])Cl)N(CC2=CC=CO2)C(=O)CCl

DOS

IR

Vibrations