Geometry & MOs

Info

ID:	265564
PubChem CID:	103530104
Reduced:	N3O3C13H19 (1)
Stoich.:	A3B3C13D19 (1)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-106.11
Dipole, Da:	5.01
IP(EA), eV:	-8.49(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-amino-2-methoxyphenyl)-(3,4-dimethoxypyrrolidin-1-yl)methanone

Drug info:

PubChemData

Smile

COC1CN(CC1OC)C(=O)C2=CC(=CC(=C2)N)N

DOS

IR

Vibrations