Geometry & MOs

Info

ID:	276205
PubChem CID:	103821229
Reduced:	OSN2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	-50.85
Dipole, Da:	5.76
IP(EA), eV:	-8.58(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methyl-N-[(4-methyloxan-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CCSC1CCC(C1)NC(=O)C2=CC(=C(C=C2)N)C

DOS

IR

Vibrations