Geometry & MOs

Info

ID:	435728
PubChem CID:	135192256
Reduced:	ClN2O4C31H33 (1)
Stoich.:	AB2C4D31E33 (1)
Weight, g/mol:	144.089878
ΔH_f, kcal/mol:	-114.07
Dipole, Da:	4.36
IP(EA), eV:	-8.35(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-aminomorpholin-2-yl)ethenol

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=C(C2=NC(=CN2C=C1C)C3=CC(=CC=C3)Cl)C4=CC5=C(C=C4)OCCC5)OC(C)(C)C

DOS

IR

Vibrations