Geometry & MOs

Info

ID:	178793
PubChem CID:	76382911
Reduced:	O7N8C28H42 (1)
Stoich.:	A7B8C28D42 (1)
Weight, g/mol:	327.127072
ΔH_f, kcal/mol:	-279.57
Dipole, Da:	5.52
IP(EA), eV:	-9.32(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-1-[(4-fluorophenyl)methyl]-3-methyl-4-oxoazetidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1C(=O)NC(C(=O)NCC(=O)NC(C(=O)N(C(C(=O)N1C)CC2=CC=CC=C2)C)CC(=O)O)CCCN=C(N)N

DOS

IR

Vibrations