Geometry & MOs

Info

ID:	445174
PubChem CID:	135264778
Reduced:	O4N9H25C30 (1)
Stoich.:	A4B9C25D30 (1)
Weight, g/mol:	278.153147
ΔH_f, kcal/mol:	77.89
Dipole, Da:	9.63
IP(EA), eV:	-9.06(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methylidene-N'-(2-methylprop-1-enyl)-3-(2-methylpyrimidin-4-yl)benzenecarboximidamide

Drug info:

PubChemData

Smile

CC(C)C1=C(N=C2C(=CNN2C1=O)C#N)C3=CN(C(=O)C=C3)CCC(C)C4=C(N=C5C(=CNN5C4=O)C#N)C6=CC=CO6

DOS

IR

Vibrations