Geometry & MOs

Info

ID:	247170
PubChem CID:	103068409
Reduced:	NSC14H21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	209.098669
ΔH_f, kcal/mol:	13.75
Dipole, Da:	2.23
IP(EA), eV:	-8.36(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(5-methylpyrimidin-2-yl)sulfanylmethyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)SCC(=C)CNC(C)C

DOS

IR

Vibrations