Geometry & MOs

Info

ID:	252600
PubChem CID:	103112567
Reduced:	N3O4C14H19 (1)
Stoich.:	A3B4C14D19 (1)
Weight, g/mol:	257.137556
ΔH_f, kcal/mol:	-160.26
Dipole, Da:	8.22
IP(EA), eV:	-9.3(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]carbamoyl]azetidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)NC1=CC=CC(=C1)C(=O)O

DOS

IR

Vibrations