Geometry & MOs

Info

ID:	324144
PubChem CID:	126677024
Reduced:	NS4O8C36H59 (1)
Stoich.:	AB4C8D36E59 (1)
Weight, g/mol:	357.18009
ΔH_f, kcal/mol:	-360.48
Dipole, Da:	3.77
IP(EA), eV:	-8.75(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[amino-[(Z)-2-amino-3-hydroxybut-1-enyl]amino]cyclobutyl]-5-phenyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(CCCS/C=C\C(=O)OCCCOC(=O)/C=C\SN(C)C)C(C)(C)S/C=C/C(=O)OCCCOC(=O)/C=C/SCCCCC(C)(C)C

DOS

IR

Vibrations