Geometry & MOs

Info

ID:	277223
PubChem CID:	103827348
Reduced:	NSO2C17H23 (1)
Stoich.:	ABC2D17E23 (1)
Weight, g/mol:	304.05751
ΔH_f, kcal/mol:	-50.7
Dipole, Da:	2.07
IP(EA), eV:	-9.18(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromopyridin-3-yl)methyl]-1-(4-ethylphenyl)methanamine

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)CNCC(COCC2=CC=CS2)O

DOS

IR

Vibrations