Geometry & MOs

Info

ID:	188969
PubChem CID:	77795749
Reduced:	N3O5C10H15 (1)
Stoich.:	A3B5C10D15 (1)
Weight, g/mol:	511.195465
ΔH_f, kcal/mol:	-186.15
Dipole, Da:	4.57
IP(EA), eV:	-10.38(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-oxo-4-[[2-oxo-2-[(2-oxo-2-prop-2-enoxyethyl)amino]-1-phenylethyl]amino]-3-(phenylmethoxycarbonylamino)butanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)CCNC(=O)C1=NNC(=O)O1

DOS

IR

Vibrations