Geometry & MOs

Info

ID:	134849
PubChem CID:	51768056
Reduced:	N2O3C20H28 (1)
Stoich.:	A2B3C20D28 (1)
Weight, g/mol:	374.256943
ΔH_f, kcal/mol:	-115.77
Dipole, Da:	5.27
IP(EA), eV:	-9.21(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-methyl-N-[(Z,2S)-1-oxo-1-(2,4,4-trimethylpentan-2-ylamino)pent-3-en-2-yl]benzamide

Drug info:

PubChemData

Smile

C/C=C/[C@H](C(=O)NC1CCCCC1)N(C)C(=O)C2=CC=CC=C2OC

DOS

IR

Vibrations