Geometry & MOs

Info

ID:	174378
PubChem CID:	75757717
Reduced:	N2O7C28H30 (1)
Stoich.:	A2B7C28D30 (1)
Weight, g/mol:	468.298808
ΔH_f, kcal/mol:	-220.21
Dipole, Da:	6.72
IP(EA), eV:	-8.96(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-cyclohexyl-2-oxoethyl]-3-(4-methoxyphenyl)-N-[(5-methylfuran-2-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN(C(C2=CC3=C(C=C2)OCO3)C(=O)NC4CCCCC4)C(=O)C5=C(C(=CC=C5)O)O

DOS

IR

Vibrations