Geometry & MOs

Info

ID:	135218
PubChem CID:	51835535
Reduced:	NO3C15H18 (2)
Stoich.:	AB3C15D18 (2)
Weight, g/mol:	474.251858
ΔH_f, kcal/mol:	-200.42
Dipole, Da:	2.66
IP(EA), eV:	-8.63(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-(cyclohexylamino)-1-(2-methylphenyl)-2-oxoethyl]-4-methoxy-N-[(5-methylfuran-2-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN([C@@H](C2=CC3=C(C=C2)OCO3)C(=O)NC(C)(C)CC(C)(C)C)C(=O)C4=CC=CC=C4O

DOS

IR

Vibrations