Geometry & MOs

Info

ID:	132143
PubChem CID:	51313318
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-90.61
Dipole, Da:	4.65
IP(EA), eV:	-8.28(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-[[2-(3-methoxyphenyl)pyrrolidin-1-yl]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)NC(=O)CN2CCCC2C3=CC(=CC=C3)OC

DOS

IR

Vibrations