Geometry & MOs

Info

ID:	203956
PubChem CID:	79893508
Reduced:	ON3C15H15 (1)
Stoich.:	AB3C15D15 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	33.36
Dipole, Da:	1.4
IP(EA), eV:	-8.06(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2-methoxycyclopentyl)-1,3-benzoxazole-2,4-diamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(C)C2=NC3=C(C=CC=C3O2)N

DOS

IR

Vibrations