Geometry & MOs

Info

ID:	172078
PubChem CID:	75464222
Reduced:	NOC16H23 (1)
Stoich.:	ABC16D23 (1)
Weight, g/mol:	330.157957
ΔH_f, kcal/mol:	-43.21
Dipole, Da:	4.38
IP(EA), eV:	-9.04(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(dimethylamino)phenyl]methyl 4-(furan-2-carbonylamino)butanoate

Drug info:

PubChemData

Smile

CC/C(=C/C(=O)N(CC)CC)/C1=CC=C(C=C1)C

DOS

IR

Vibrations