Geometry & MOs

Info

ID:	37899
PubChem CID:	8025399
Reduced:	ON4C23H26 (1)
Stoich.:	AB4C23D26 (1)
Weight, g/mol:	374.163043
ΔH_f, kcal/mol:	99.25
Dipole, Da:	14.9
IP(EA), eV:	-5.16(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(4-phenylanilino)propanamide

Drug info:

PubChemData

Smile

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C4=CC=CC=[NH+]4

DOS

IR

Vibrations