Geometry & MOs

Info

ID:	24721
PubChem CID:	612612
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-140.04
Dipole, Da:	2.09
IP(EA), eV:	-9.49(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-2-formamido-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1(OCC(C(O1)C2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)NC=O)C

DOS

IR

Vibrations