Geometry & MOs

Info

ID:	135236
PubChem CID:	51838288
Reduced:	NO2C15H19 (2)
Stoich.:	AB2C15D19 (2)
Weight, g/mol:	490.283158
ΔH_f, kcal/mol:	-130.14
Dipole, Da:	4.78
IP(EA), eV:	-8.76(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-N-butyl-2-[3-(4-methoxyphenyl)propanoyl-[(5-methylfuran-2-yl)methyl]amino]-3-phenylbutanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H]([C@H](C)C1=CC=CC=C1)N(CC2=CC=C(O2)C)C(=O)CCC3=CC=C(C=C3)OC

DOS

IR

Vibrations