Geometry & MOs

Info

ID:	202433
PubChem CID:	79672024
Reduced:	N3C14H25 (1)
Stoich.:	A3B14C25 (1)
Weight, g/mol:	298.098728
ΔH_f, kcal/mol:	3.24
Dipole, Da:	1.57
IP(EA), eV:	-8.78(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[bis(2-hydroxyethyl)amino]ethylsulfonyl]benzonitrile

Drug info:

PubChemData

Smile

CC1CC(CCC1NCC2=CN(N=C2)C)(C)C

DOS

IR

Vibrations