Geometry & MOs

Info

ID:	203902
PubChem CID:	79890107
Reduced:	ON4C14H20 (1)
Stoich.:	AB4C14D20 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	9.57
Dipole, Da:	3.61
IP(EA), eV:	-7.96(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-pentan-3-yl-1,3-benzoxazole-2,4-diamine

Drug info:

PubChemData

Smile

CN(C)C1CCN(CC1)C2=NC3=C(C=CC=C3O2)N

DOS

IR

Vibrations