Geometry & MOs

Info

ID:	237371
PubChem CID:	92718909
Reduced:	O2N3C17H17 (1)
Stoich.:	A2B3C17D17 (1)
Weight, g/mol:	300.111007
ΔH_f, kcal/mol:	-24.44
Dipole, Da:	4.35
IP(EA), eV:	-9.38(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-[(2S)-2,3-dihydro-1-benzofuran-2-yl]-(2-methoxy-5-nitrophenyl)methanamine

Drug info:

PubChemData

Smile

C1C(=O)NC2=C(C=C(C=C2)[C@H](CC3=CC=CC=C3)N)NC1=O

DOS

IR

Vibrations