Geometry & MOs

Info

ID:	249923
PubChem CID:	103092887
Reduced:	NC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	191.142248
ΔH_f, kcal/mol:	22.48
Dipole, Da:	3.7
IP(EA), eV:	-9.09(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N,3-dimethyl-4-(2-methylpyrimidin-4-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=NC=C1)/C=C(\C)/C(C)NC

DOS

IR

Vibrations