Geometry & MOs

Info

ID:	286784
PubChem CID:	104222374
Reduced:	N5C10H13 (1)
Stoich.:	A5B10C13 (1)
Weight, g/mol:	245.164046
ΔH_f, kcal/mol:	76.36
Dipole, Da:	6.61
IP(EA), eV:	-9.26(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[[2-(2-methylimidazol-1-yl)pyrimidin-5-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=NC=CN1C2=NC=C(C=N2)CNC

DOS

IR

Vibrations