Geometry & MOs

Info

ID:	189970
PubChem CID:	77934420
Reduced:	O3N5C18H21 (1)
Stoich.:	A3B5C18D21 (1)
Weight, g/mol:	279.101919
ΔH_f, kcal/mol:	-65.27
Dipole, Da:	2.56
IP(EA), eV:	-9.16(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-amino-4,4a,5,7-tetrahydrofuro[3,4-d][1,3]oxazin-7a-yl)-4-fluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2(CC(C(O2)CO)O)N3C=NC4=C(N=CN=C43)N

DOS

IR

Vibrations