Geometry & MOs

Info

ID:	134514
PubChem CID:	51709354
Reduced:	N3O3C26H35 (1)
Stoich.:	A3B3C26D35 (1)
Weight, g/mol:	385.236542
ΔH_f, kcal/mol:	-107.0
Dipole, Da:	3.73
IP(EA), eV:	-8.67(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-[[(2R)-2-(dimethylamino)-2-(4-ethylphenyl)ethyl]amino]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)N[C@H](C(C)C)C(=O)NC[C@@H](C2=CC=CC=C2OC)N3CCCC3

DOS

IR

Vibrations