Geometry & MOs

Info

ID:	249728
PubChem CID:	103091659
Reduced:	N2C11H16 (1)
Stoich.:	A2B11C16 (1)
Weight, g/mol:	177.126598
ΔH_f, kcal/mol:	20.69
Dipole, Da:	5.39
IP(EA), eV:	-9.52(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-methyl-4-(2-methylpyrimidin-4-yl)but-3-en-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations