Geometry & MOs

Info

ID:	286785
PubChem CID:	104222375
Reduced:	N5C13H19 (1)
Stoich.:	A5B13C19 (1)
Weight, g/mol:	267.148396
ΔH_f, kcal/mol:	59.31
Dipole, Da:	6.67
IP(EA), eV:	-9.25(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations