Geometry & MOs

Info

ID:	315935
PubChem CID:	126629464
Reduced:	N5O7C32H43 (1)
Stoich.:	A5B7C32D43 (1)
Weight, g/mol:	389.11028
ΔH_f, kcal/mol:	-278.83
Dipole, Da:	6.78
IP(EA), eV:	-9.31(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC1=NC2=C(C=CC(=C2)/C=C/[C@H](C(C)OC(=O)C)C(=O)NC(C(C)C)C(=O)NC(C)C(=O)N3CCCC(N3)C(=O)O)C=C1

DOS

IR

Vibrations