Geometry & MOs

Info

ID:	264448
PubChem CID:	103462532
Reduced:	SN3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	218.141913
ΔH_f, kcal/mol:	5.51
Dipole, Da:	4.57
IP(EA), eV:	-8.79(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethylbutyl)-1,3-benzoxazol-2-amine

Drug info:

PubChemData

Smile

CCC1=NSC(=N1)NCC(C)(C)CC

DOS

IR

Vibrations