Geometry & MOs

Info

ID:	286782
PubChem CID:	104222371
Reduced:	N5C14H21 (1)
Stoich.:	A5B14C21 (1)
Weight, g/mol:	231.148396
ΔH_f, kcal/mol:	60.48
Dipole, Da:	4.65
IP(EA), eV:	-9.06(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=NC=C(C=N2)CNC(C)(C)C)C

DOS

IR

Vibrations