Geometry & MOs

Info

ID:	174375
PubChem CID:	75757714
Reduced:	N2O5C30H38 (1)
Stoich.:	A2B5C30D38 (1)
Weight, g/mol:	450.215472
ΔH_f, kcal/mol:	-186.3
Dipole, Da:	3.35
IP(EA), eV:	-9.1(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]-2,3-dihydroxy-N-[(5-methylfuran-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C(=O)NC(C)(C)CC(C)(C)C)N(CC2=CC=C(O2)C)C(=O)C3=C(C(=CC=C3)O)O

DOS

IR

Vibrations