Geometry & MOs

Info

ID:	203893
PubChem CID:	79889757
Reduced:	SO2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	-43.46
Dipole, Da:	6.03
IP(EA), eV:	-8.8(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)S(=O)(=O)NC2=C(N=CC=C2)C)C)N

DOS

IR

Vibrations