Geometry & MOs

Info

ID:	138391
PubChem CID:	52358415
Reduced:	ON4C17H18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	371.184506
ΔH_f, kcal/mol:	19.71
Dipole, Da:	2.88
IP(EA), eV:	-8.46(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)NCC3=CC=CC=N3

DOS

IR

Vibrations