Geometry & MOs

Info

ID:	135240
PubChem CID:	51838631
Reduced:	SN2O4C26H38 (1)
Stoich.:	AB2C4D26E38 (1)
Weight, g/mol:	488.267508
ΔH_f, kcal/mol:	-165.9
Dipole, Da:	2.2
IP(EA), eV:	-8.83(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(1S)-2-(cyclohexylamino)-1-(4-hydroxyphenyl)-2-oxoethyl]-N-[(5-methylfuran-2-yl)methyl]-3-phenylbutanamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN([C@H](C2=CC=C(C=C2)OC)C(=O)NC(C)(C)CC(C)(C)C)C(=O)CCS

DOS

IR

Vibrations