Geometry & MOs

Info

ID:	398213
PubChem CID:	135032326
Reduced:	O2N7C24H35 (1)
Stoich.:	A2B7C24D35 (1)
Weight, g/mol:	387.211276
ΔH_f, kcal/mol:	-19.62
Dipole, Da:	10.67
IP(EA), eV:	-8.7(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C/C=C\CN=C(N)NC[C@H]1[C@@H]2CCN([C@@H]2C3=C(N1)C=CC(=C3)C(=O)O)C(=NCC=C(C)C)N

DOS

IR

Vibrations