Geometry & MOs

Info

ID:	243385
PubChem CID:	99222738
Reduced:	N2O4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	392.173607
ΔH_f, kcal/mol:	-121.58
Dipole, Da:	7.08
IP(EA), eV:	-9.35(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-2-oxo-N-[(1S)-1-(4-propylphenyl)ethyl]chromene-3-carboxamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)[C@@H](C)N(CC(=O)N)C(=O)C2=CC3=CC=CC=C3OC2=O

DOS

IR

Vibrations